Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | RARB | P10826 | 8/20 | 0.49 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | RARA | P10276 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.48 |
| ▸ | PTGES | O14684 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.45 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27644441 | 0.98 | LTB4R2 (0.49) | TP53TSHRRARBPLA2G4BMEN1 | |
| SCHEMBL12352210 | 0.90 | PGR (0.50) | TSHRALDH1A1HSD17B3 | |
| SCHEMBL26614476 | 0.85 | NPC1 (0.53) | TP53MEN1ALDH1A1KMT2ALTB4R2 | |
| SCHEMBL26614645 | 0.85 | NPC1 (0.53) | TP53MEN1ALDH1A1KMT2ALTB4R2 | |
| SCHEMBL11515226 | 0.85 | NPC1 (0.53) | TP53MEN1ALDH1A1KMT2ALTB4R2 | |
| SCHEMBL4130517 | 0.85 | NPC1 (0.53) | TP53MEN1ALDH1A1KMT2ALTB4R2 | |
| SCHEMBL10407826 | 0.85 | NPC1 (0.53) | TP53MEN1ALDH1A1KMT2ALTB4R2 | |
| SCHEMBL27351408 | 0.83 | CES2 (0.50) | TP53ALDH1A1KMT2ALTB4R2ALOX5 | |
| SCHEMBL20577016 | 0.83 | LTB4R2 (0.56) | TP53TSHRRARBPLA2G4BMEN1 | |
| SCHEMBL4137831 | 0.83 | FOLH1 (0.51) | LTB4R2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1205335-A | Tricyclic diazepine vasopression antagonists | AMERICAN CYANAMID CO (US) | 1999-01-20 | — | — | CN | disclosed |
| CN-1106812-A | Tricyclic diaza * vasopressin antagonists and oxytocin antagonists | AMERICAN CYANAMID CO (US) | 1995-08-16 | — | — | CN | disclosed |
| US-4442090-A | ACYLATED AMINO ACID | KYOTO YAKUHIN KOGYO KABUSHIKI KAISHA (JP) | 1984-04-10 | — | — | US | disclosed |